Sugi Predict

Sugi Predict / Compounds / SCHEMBL10768629

SCHEMBL10768629

SCHEMBL10768629

C=CCOC(=O)N1C(=O)c2ccccc2C1=O

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.63
▸ ALDH1A1 P00352 4/20 0.56
▸ CYP3A4 P08684 1/20 0.50
▸ RHOA P61586 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CASP3 P42574 1/20 0.42
▸ CTRB1 P17538 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ PKM P14618 1/20 0.40
▸ PTPRC P08575 1/20 0.40
▸ CA12 O43570 1/20 0.40
▸ CA9 Q16790 1/20 0.40
▸ MAPT P10636 1/20 0.39
▸ FGFR1 P11362 1/20 0.39
▸ LMNA P02545 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ RAB9A P51151 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18485459 0.86 FGFR1 (0.51) NPSR1ALDH1A1CYP3A4HSD17B10SMN1; SMN2
SCHEMBL18485457 0.81 NPSR1 (0.44) NPSR1ALDH1A1CYP3A4RHOATSHR
SCHEMBL74973 0.79 L3MBTL1 (0.55) ALDH1A1TSHRHSD17B10CTRB1CA12
SCHEMBL31241181 0.79 L3MBTL1 (0.55) ALDH1A1TSHRHSD17B10CTRB1CA12
SCHEMBL28402282 0.78 NPSR1 (0.60) NPSR1ALDH1A1CYP3A4RHOAPOLB
SCHEMBL12277494 0.76 NPSR1 (0.58) NPSR1ALDH1A1CYP3A4RHOAPOLB
SCHEMBL23812541 0.75 NPSR1 (0.40) NPSR1ALDH1A1CYP3A4TSHRHSD17B10
SCHEMBL8521913 0.75 CYP3A4 (0.43) NPSR1ALDH1A1CYP3A4RHOATSHR
SCHEMBL19848584 0.75 CYP2D6 (0.62) NPSR1ALDH1A1RHOATSHRCA12
Ethylene Glycol SCHEMBL8989789 0.75 L3MBTL1 (0.51) NPSR1ALDH1A1TSHRHSD17B10CTRB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0233733-A2 Process for producing N-phthaloyl-p-nitro-L-phenylalanine KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-08-26 — — EP claimed
US-20210328266-A1 Electrolyte Solution For Lithium Secondary Battery and Lithium Secondary Battery Including the Same LG ENERGY SOLUTION, LTD. (KR) 2021-10-21 — — US disclosed
WO-2020130575-A1 ELECTROLYTE FOR LITHIUM SECONDARY BATTERY, AND LITHIUM SECONDARY BATTERY COMPRISING SAME 주식회사 엘지화학 2020-06-25 — — WO disclosed
US-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 — — US disclosed
US-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 — — US disclosed
US-20170117588-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) 2017-04-27 — — US disclosed
EP-3131153-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals Co., Ltd. (JP) 2017-02-15 — — EP disclosed
EP-3131153-A1 ADDITIVE FOR NON-AQUEOUS ELECTROLYTE, NON-AQUEOUS ELECTROLYTE, AND POWER STORAGE DEVICE Sumitomo Seika Chemicals Co., Ltd. (JP) 2017-02-15 — — EP disclosed
CN-106133984-A Addition agent of non-aqueous electrolyte, nonaqueous electrolytic solution and electrical storage device 住友精化株式会社 2016-11-16 — — CN disclosed
EP-0233733-A2 Process for producing N-phthaloyl-p-nitro-L-phenylalanine KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1987-08-26 — — EP disclosed